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PALIURINE-B
SpectraBase Compound ID 2XC8SwH8odK
InChI InChI=1S/C36H49N5O6/c1-7-22(3)30(37-5)34(43)39-27(20-24-12-10-9-11-13-24)36(45)41-19-17-29-32(41)35(44)40-31(23(4)8-2)33(42)38-18-16-25-21-26(47-29)14-15-28(25)46-6/h9-16,18,21-23,27,29-32,37H,7-8,17,19-20H2,1-6H3,(H,38,42)(H,39,43)(H,40,44)/b18-16-
InChIKey CDQIHKYZYILDAS-VLGSPTGOSA-N
Mol Weight 647.8 g/mol
Molecular Formula C36H49N5O6
Exact Mass 647.368284 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hekst0dGVLy
Name PALIURINE-B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H49N5O6
InChI InChI=1S/C36H49N5O6/c1-7-22(3)30(37-5)34(43)39-27(20-24-12-10-9-11-13-24)36(45)41-19-17-29-32(41)35(44)40-31(23(4)8-2)33(42)38-18-16-25-21-26(47-29)14-15-28(25)46-6/h9-16,18,21-23,27,29-32,37H,7-8,17,19-20H2,1-6H3,(H,38,42)(H,39,43)(H,40,44)/b18-16-
InChIKey CDQIHKYZYILDAS-VLGSPTGOSA-N
Literature Reference Author H.Y.LIN,C.H.CHEN,B.J.YOU,K.C.S.C.LIU,S.S.LEE
Literature Reference Citation J.NAT.PROD.,63,1338(2000)
Literature Reference DOI 10.1021/np000136a
Molecular Weight 647.815 g/mol
Solvent CDCl3
Source File Reference UWRU2152